| SpectraBase Compound ID | CO4fgnKiWBU |
|---|---|
| InChI | InChI=1S/C38H50O20/c1-16-26(43)29(46)32(49)36(53-16)57-34-30(47)27(44)17(2)54-37(34)58-35-31(48)28(45)24(15-39)55-38(35)56-33-22(50-3)13-19(14-23(33)51-4)6-5-11-52-25(42)10-8-18-7-9-20(40)21(41)12-18/h5-10,12-14,16-17,24,26-32,34-41,43-49H,11,15H2,1-4H3/b6-5+,10-8+/t16-,17-,24+,26-,27-,28+,29+,30+,31-,32+,34+,35+,36-,37-,38-/m0/s1 |
| InChIKey | MYOGRNWRSTZKJK-HNGQABMHSA-N |
| Mol Weight | 826.8 g/mol |
| Molecular Formula | C38H50O20 |
| Exact Mass | 826.289544 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2MOGk9mACuN |
|---|---|
| Name | SOLARGIN-IV;SINAPYL-ALCOHOL-9-O-CAFFEOYL-4-O-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-BETA-GLUOCPYRANOSIDE |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C38H50O20 |
| InChI | InChI=1S/C38H50O20/c1-16-26(43)29(46)32(49)36(53-16)57-34-30(47)27(44)17(2)54-37(34)58-35-31(48)28(45)24(15-39)55-38(35)56-33-22(50-3)13-19(14-23(33)51-4)6-5-11-52-25(42)10-8-18-7-9-20(40)21(41)12-18/h5-10,12-14,16-17,24,26-32,34-41,43-49H,11,15H2,1-4H3/b6-5+,10-8+/t16-,17-,24+,26-,27-,28+,29+,30+,31-,32+,34+,35+,36-,37-,38-/m0/s1 |
| InChIKey | MYOGRNWRSTZKJK-HNGQABMHSA-N |
| Literature Reference Author | M.S.KAMEL |
| Literature Reference Citation | PHYTOCHEM.,62,1247(2003) |
| Literature Reference DOI | 10.1016/S0031-9422(03)00022-0 |
| Molecular Weight | 826.803 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWLU29648 |